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["Mol ID","Molecule Name","MW","AlogP","Hdon","Hacc","OB (%)","Caco-2","BBB","DL","FASA-","HL"]
["MOL001454","berberine",336.39,3.45,0,4,36.86,1.24,0.57,0.78,0.19,6.57]
["MOL013352","Obacunone",454.56,2.68,0,7,43.29,0.01,-0.43,0.77,0.31,-13.04]
["MOL002894","berberrubine",322.36,3.2,1,4,35.74,1.07,0.17,0.73,0.24,6.46]
["MOL002897","epiberberine",336.39,3.45,0,4,43.09,1.17,0.4,0.78,0.19,6.1]
["MOL002903","(R)-Canadine",339.42,3.4,0,5,55.37,1.04,0.57,0.77,0.2,6.41]
["MOL002904","Berlambine",351.38,2.49,0,6,36.68,0.97,0.17,0.82,0.28,7.33]
["MOL002907","Corchoroside A_qt",404.55,1.34,3,6,104.95,-0.91,-1.31,0.78,0.29,6.68]
["MOL000622","Magnograndiolide",266.37,1.18,2,4,63.71,0.02,-0.24,0.19,0.3,3.17]
["MOL000762","Palmidin A",510.52,4.52,6,8,35.36,-0.38,-1.47,0.65,0.39,33.17]
["MOL000785","palmatine",352.44,3.65,0,4,64.6,1.33,0.37,0.65,0.13,2.25]
["MOL000098","quercetin",302.25,1.5,5,7,46.43,0.05,-0.77,0.28,0.38,14.4]
["MOL001458","coptisine",320.34,3.25,0,4,30.67,1.21,0.32,0.86,0.26,9.33]
["MOL002668","Worenine",334.37,3.73,0,4,45.83,1.22,0.24,0.87,0.27,8.41]
["MOL008647","Moupinamide",313.38,2.86,3,5,86.71,0.55,-0.51,0.26,0.33,3.71]
["MOL001689","acacetin",284.28,2.59,2,5,34.97,0.67,-0.05,0.24,0.35,17.25]
["MOL000173","wogonin",284.28,2.59,2,5,30.68,0.79,0.04,0.23,0.32,17.75]
["MOL000228","(2R)-7-hydroxy-5-methoxy-2-phenylchroman-4-one",270.3,2.82,1,4,55.23,0.87,0.26,0.2,0.34,17.02]
["MOL002714","baicalein",270.25,2.33,3,5,33.52,0.63,-0.05,0.21,0.36,16.25]
["MOL002908","5,8,2'-Trihydroxy-7-methoxyflavone",300.28,2.32,3,6,37.01,0.76,-0.07,0.27,0.28,16.17]
["MOL002909","5,7,2,5-tetrahydroxy-8,6-dimethoxyflavone",376.34,2.02,4,9,33.82,0.35,-0.59,0.45,0.19,15.94]
["MOL002910","Carthamidin",288.27,2.03,4,6,41.15,0.16,-0.42,0.24,0.36,15.81]
["MOL002911","2,6,2',4'-tetrahydroxy-6'-methoxychaleone",302.3,2.62,4,6,69.04,-0.07,-0.32,0.22,0.34,21.89]
["MOL002913","Dihydrobaicalin_qt",272.27,2.3,3,5,40.04,0.56,0.18,0.21,0.36,16.13]
["MOL002914","Eriodyctiol (flavanone)",288.27,2.03,4,6,41.35,0.05,-0.66,0.24,0.39,15.88]
["MOL002915","Salvigenin",328.34,2.82,1,6,49.07,0.86,-0.03,0.33,0.21,15.87]
["MOL002917","5,2',6'-Trihydroxy-7,8-dimethoxyflavone",330.31,2.3,3,7,45.05,0.48,-0.11,0.33,0.25,16.37]
["MOL002925","5,7,2',6'-Tetrahydroxyflavone",286.25,2.07,4,6,37.01,0.18,-0.56,0.24,0.38,18]
["MOL002926","dihydrooroxylin A",286.3,2.55,2,5,38.72,0.71,0.03,0.23,0.29,17.58]
["MOL002927","Skullcapflavone II",374.37,2.54,2,8,69.51,0.68,-0.07,0.44,0.2,16.14]
["MOL002928","oroxylin a",284.28,2.59,2,5,41.37,0.76,0.13,0.23,0.29,17.15]
["MOL002932","Panicolin",314.31,2.57,2,6,76.26,0.84,0.31,0.29,0.24,16.78]
["MOL002933","5,7,4'-Trihydroxy-8-methoxyflavone",300.28,2.32,3,6,36.56,0.46,-0.4,0.27,0.31,16.93]
["MOL002934","NEOBAICALEIN",374.37,2.54,2,8,104.34,0.74,-0.19,0.44,0.18,16.5]
["MOL002937","DIHYDROOROXYLIN",286.3,2.55,2,5,66.06,0.67,0.13,0.23,0.31,17.17]
["MOL000358","beta-sitosterol",414.79,8.08,1,1,36.91,1.32,0.99,0.75,0.23,5.36]
["MOL000359","sitosterol",414.79,8.08,1,1,36.91,1.32,0.87,0.75,0.22,5.37]
["MOL000525","Norwogonin",270.25,2.33,3,5,39.4,0.6,-0.17,0.21,0.39,16.93]
["MOL000552","5,2'-Dihydroxy-6,7,8-trimethoxyflavone",344.34,2.55,2,7,31.71,0.93,0,0.35,0.22,16.47]
["MOL000073","ent-Epicatechin",290.29,1.92,5,6,48.96,0.02,-0.64,0.24,0.34,0.63]
["MOL000449","Stigmasterol",412.77,7.64,1,1,43.83,1.44,1,0.76,0.22,5.57]
["MOL001458","coptisine",320.34,3.25,0,4,30.67,1.21,0.32,0.86,0.26,9.33]
["MOL001490","bis[(2S)-2-ethylhexyl] benzene-1,2-dicarboxylate",390.62,7.57,0,4,43.59,0.98,0.68,0.35,0.28,3.02]
["MOL001506","Supraene",410.8,11.33,0,0,33.55,2.08,1.73,0.42,0.27,2.72]
["MOL002879","Diop",390.62,7.44,0,4,43.59,0.79,0.26,0.39,0.28,3.6]
["MOL002897","epiberberine",336.39,3.45,0,4,43.09,1.17,0.4,0.78,0.19,6.1]
["MOL008206","Moslosooflavone",298.31,2.84,1,5,44.09,1.01,0.54,0.25,0.26,17.02]
["MOL010415","11,13-Eicosadienoic acid, methyl ester",322.59,7.55,0,2,39.28,1.46,1.24,0.23,0.21,5.44]
["MOL012245","5,7,4'-trihydroxy-6-methoxyflavanone",302.3,2.28,3,6,36.63,0.43,-0.32,0.27,0.28,16.12]
["MOL012246","5,7,4'-trihydroxy-8-methoxyflavanone",302.3,2.28,3,6,74.24,0.37,-0.43,0.26,0.31,16.85]
["MOL012266","rivularin",344.34,2.55,2,7,37.94,0.65,-0.13,0.37,0.21,16.25]
["MOL001454","berberine",336.39,3.45,0,4,36.86,1.24,0.57,0.78,0.19,6.57]
["MOL001458","coptisine",320.34,3.25,0,4,30.67,1.21,0.32,0.86,0.26,9.33]
["MOL002636","Kihadalactone A",512.7,3.96,0,7,34.21,0.19,-0.51,0.82,0.29,-6.27]
["MOL013352","Obacunone",454.56,2.68,0,7,43.29,0.01,-0.43,0.77,0.31,-13.04]
["MOL002641","Phellavin_qt",374.42,2.51,5,7,35.86,-0.41,-1.32,0.44,0.33,15.81]
["MOL002643","delta 7-stigmastenol",414.79,8.08,1,1,37.42,1.3,0.83,0.75,0.22,5.27]
["MOL002644","Phellopterin",300.33,3.64,0,5,40.19,0.98,0.48,0.28,0.24,-1.64]
["MOL002651","Dehydrotanshinone II A",292.35,4.22,0,3,43.76,1.02,0.52,0.4,0.33,23.71]
["MOL002652","delta7-Dehydrosophoramine",242.35,1.09,0,3,54.45,0.99,0.75,0.25,0.22,5.52]
["MOL002656","dihydroniloticin",458.8,5.66,2,3,36.43,0.65,0.03,0.81,0.25,7.04]
["MOL002659","kihadanin A",486.56,1.76,1,9,31.6,-0.93,-1.36,0.7,0.38,2.68]
["MOL002660","niloticin",456.78,5.62,1,3,41.41,0.54,-0.2,0.82,0.27,5.19]
["MOL002662","rutaecarpine",287.34,3.36,1,3,40.3,1.13,0.71,0.6,0.33,8.21]
["MOL002663","Skimmianin",259.28,2.33,0,5,40.14,1.26,1.1,0.2,0.14,-2.43]
["MOL002666","Chelerythrine",332.37,4.29,0,4,34.18,1.24,0.28,0.78,0.36,6.32]
["MOL000449","Stigmasterol",412.77,7.64,1,1,43.83,1.44,1,0.76,0.22,5.57]
["MOL002668","Worenine",334.37,3.73,0,4,45.83,1.22,0.24,0.87,0.27,8.41]
["MOL002670","Cavidine",353.45,3.72,0,5,35.64,1.08,0.63,0.81,0,5.78]
["MOL002671","Candletoxin A",608.79,3.63,2,9,31.81,-0.39,-1.24,0.69,0.32,-0.36]
["MOL002672","Hericenone H",580.88,9.95,0,6,39,0.8,0.16,0.63,0.22,3.62]
["MOL002673","Hispidone",472.78,4.46,2,4,36.18,0.12,-0.72,0.83,0.25,5.08]
["MOL000358","beta-sitosterol",414.79,8.08,1,1,36.91,1.32,0.99,0.75,0.23,5.36]
["MOL000622","Magnograndiolide",266.37,1.18,2,4,63.71,0.02,-0.24,0.19,0.3,3.17]
["MOL000762","Palmidin A",510.52,4.52,6,8,35.36,-0.38,-1.47,0.65,0.39,33.17]
["MOL000785","palmatine",352.44,3.65,0,4,64.6,1.33,0.37,0.65,0.13,2.25]
["MOL000787","Fumarine",353.4,2.95,0,6,59.26,0.56,-0.13,0.83,0.3,23.46]
["MOL000790","Isocorypalmine",341.44,3.35,1,5,35.77,0.85,0.43,0.59,0.21,2.47]
["MOL000098","quercetin",302.25,1.5,5,7,46.43,0.05,-0.77,0.28,0.38,14.4]
["MOL001131","phellamurin_qt",356.4,3.61,4,6,56.6,0.14,-0.5,0.39,0.38,14.89]
["MOL001455","(S)-Canadine",339.42,3.4,0,5,53.83,1.01,0.64,0.77,0.19,6.56]
["MOL001771","poriferast-5-en-3beta-ol",414.79,8.08,1,1,36.91,1.45,1.14,0.75,0,5.07]
["MOL002894","berberrubine",322.36,3.2,1,4,35.74,1.07,0.17,0.73,0.24,6.46]
["MOL005438","campesterol",400.76,7.63,1,1,37.58,1.34,0.95,0.71,0.22,4.83]
["MOL006392","dihydroniloticin",458.8,5.66,2,3,36.43,0.64,0.1,0.82,0.24,6.46]
["MOL006401","melianone",470.76,4.76,1,4,40.53,0.4,-0.31,0.78,0.27,6.09]
["MOL006413","phellochin",488.83,5.26,2,4,35.41,0.47,-0.01,0.82,0.24,6.64]
["MOL006422","thalifendine",322.36,3.2,1,4,44.41,1.12,0.21,0.73,0.22,5.99]
["MOL001406","crocetin",328.44,4.58,2,4,35.3,0.54,-0.83,0.26,0.43,2.03]
["MOL001663","(4aS,6aR,6aS,6bR,8aR,10R,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid",456.78,6.42,2,3,32.03,0.61,0.39,0.76,0.22,4.34]
["MOL001941","Ammidin",270.3,3.65,0,4,34.55,1.13,0.92,0.22,0.28,-1.35]
["MOL004561","Sudan III",352.42,7.21,1,5,84.07,0.42,0.1,0.59,0.46,8.99]
["MOL000098","quercetin",302.25,1.5,5,7,46.43,0.05,-0.77,0.28,0.38,14.4]
["MOL000358","beta-sitosterol",414.79,8.08,1,1,36.91,1.32,0.99,0.75,0.23,5.36]
["MOL000422","kaempferol",286.25,1.77,4,6,41.88,0.26,-0.55,0.24,0,14.74]
["MOL000449","Stigmasterol",412.77,7.64,1,1,43.83,1.44,1,0.76,0.22,5.57]
["MOL001494","Mandenol",308.56,6.99,0,2,42,1.46,1.14,0.19,0.25,5.39]
["MOL001506","Supraene",410.8,11.33,0,0,33.55,2.08,1.73,0.42,0.27,2.72]
["MOL001942","isoimperatorin",270.3,3.65,0,4,45.46,0.97,0.66,0.23,0.27,-1.44]
["MOL002883","Ethyl oleate (NF)",310.58,7.44,0,2,32.4,1.4,1.1,0.19,0.19,4.85]
["MOL003095","5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone",358.37,2.8,1,7,51.96,0.88,-0.21,0.41,0.17,15.98]
["MOL007245","3-Methylkempferol",300.28,1.84,3,6,60.16,0.37,-0.49,0.26,0.36,16.36]
["MOL009038","GBGB",550.57,-4,8,15,45.58,-3.29,-5.43,0.83,0.26,10.25]

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